2-(4-methoxyphenyl)quinoline-4-carboxylic acid; (4-methylphenyl)methanamine

Systemtic Name: 2-(4-methoxyphenyl)quinoline-4-carboxylic acid; (4-methylphenyl)methanamine Openeye Name: 2-(4-methoxyphenyl)quinoline-4-carboxylic acid; p-tolylmethanamine CAS Name: 2-(4-methoxyphenyl)-4-quinolinecarboxylic acid; (4-methylphenyl)methanamine IUPAC Name: 2-(4-methoxyphenyl)quinoline-4-carboxylic acid; (4-methylphenyl)methanamine Traditional Name: 2-(4-methoxyphenyl)cinchoninic acid; (4-methylbenzyl)amine Formula: C25H24N2O3 MolecularWeight: 400.46966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN.COC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)CN.COC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)O

InChI

InChI=1S/C17H13NO3.C8H11N/c1-21-12-8-6-11(7-9-12)16-10-14(17(19)20)13-4-2-3-5-15(13)18-16;1-7-2-4-8(6-9)5-3-7/h2-10H,1H3,(H,19,20);2-5H,6,9H2,1H3